(5-cyclopropyl-1H-pyrazol-4-yl)methanol

C7H10N2O — CID 66442627

IUPAC(5-cyclopropyl-1H-pyrazol-4-yl)methanol
SMILESOCc1cn[nH]c1C1CC1
InChIInChI=1S/C7H10N2O/c10-4-6-3-8-9-7(6)5-1-2-5/h3,5,10H,1-2,4H2,(H,8,9)
InChIKeyNNBZLFLNYQCIPN-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.78
Rot. Bonds2

About (5-cyclopropyl-1H-pyrazol-4-yl)methanol

(5-cyclopropyl-1H-pyrazol-4-yl)methanol (PubChem CID 66442627) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is (5-cyclopropyl-1H-pyrazol-4-yl)methanol.

Molecular Properties

Compound Name(5-cyclopropyl-1H-pyrazol-4-yl)methanol
PubChem CID66442627
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name(5-cyclopropyl-1H-pyrazol-4-yl)methanol
SMILESOCc1cn[nH]c1C1CC1
InChIInChI=1S/C7H10N2O/c10-4-6-3-8-9-7(6)5-1-2-5/h3,5,10H,1-2,4H2,(H,8,9)
InChIKeyNNBZLFLNYQCIPN-UHFFFAOYSA-N
XLogP0.78
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1H-pyrazol-4-yl)methanol?
The IUPAC name of (5-cyclopropyl-1H-pyrazol-4-yl)methanol (CID 66442627) is (5-cyclopropyl-1H-pyrazol-4-yl)methanol.
What is the SMILES notation for (5-cyclopropyl-1H-pyrazol-4-yl)methanol?
The canonical SMILES for (5-cyclopropyl-1H-pyrazol-4-yl)methanol is OCc1cn[nH]c1C1CC1.
What is the InChIKey of (5-cyclopropyl-1H-pyrazol-4-yl)methanol?
The InChIKey is NNBZLFLNYQCIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c10-4-6-3-8-9-7(6)5-1-2-5/h3,5,10H,1-2,4H2,(H,8,9).
What are the key properties of (5-cyclopropyl-1H-pyrazol-4-yl)methanol?
(5-cyclopropyl-1H-pyrazol-4-yl)methanol has a molecular weight of 138.17 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1H-pyrazol-4-yl)methanol is sourced from PubChem (CID 66442627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).